Organic acids and derivatives
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Hexylphosphonic Acid 98.0+%, TCI America™
CAS: 4721-24-8 Molecular Formula: C6H15O3P Molecular Weight (g/mol): 166.157 MDL Number: MFCD00013961 InChI Key: GJWAEWLHSDGBGG-UHFFFAOYSA-N Synonym: n-hexylphosphonic acid,phosphonic acid, p-hexyl,hexylphosphonicacid,p-hexyl-phosphonic acid,hexylphosphonic acid PubChem CID: 312552 IUPAC Name: hexylphosphonic acid SMILES: CCCCCCP(=O)(O)O
| PubChem CID | 312552 |
|---|---|
| CAS | 4721-24-8 |
| Molecular Weight (g/mol) | 166.157 |
| MDL Number | MFCD00013961 |
| SMILES | CCCCCCP(=O)(O)O |
| Synonym | n-hexylphosphonic acid,phosphonic acid, p-hexyl,hexylphosphonicacid,p-hexyl-phosphonic acid,hexylphosphonic acid |
| IUPAC Name | hexylphosphonic acid |
| InChI Key | GJWAEWLHSDGBGG-UHFFFAOYSA-N |
| Molecular Formula | C6H15O3P |
Diethyl (Bromodifluoromethyl)phosphonate 97.0+%, TCI America™
CAS: 65094-22-6 Molecular Formula: C5H10BrF2O3P Molecular Weight (g/mol): 267.01 MDL Number: MFCD00069118 InChI Key: QRADKVYIJIAENZ-UHFFFAOYSA-N Synonym: diethyl bromodifluoromethyl phosphonate,bromodifluoromethyl diethylphosphonate,diethyl bromodifluoromethanephosphonate,diethyl bromodifluoromethylphosphonate,bromodifluoromethyl phosphonic acid diethyl ester,1-bromo difluoro methyl-ethoxyphosphoryl oxyethane,phosphonic acid, bromodifluoromethyl-, diethyl ester,pubchem24183,acmc-20ai7p PubChem CID: 144101 IUPAC Name: diethyl (bromodifluoromethyl)phosphonate SMILES: CCOP(=O)(OCC)C(F)(F)Br
| PubChem CID | 144101 |
|---|---|
| CAS | 65094-22-6 |
| Molecular Weight (g/mol) | 267.01 |
| MDL Number | MFCD00069118 |
| SMILES | CCOP(=O)(OCC)C(F)(F)Br |
| Synonym | diethyl bromodifluoromethyl phosphonate,bromodifluoromethyl diethylphosphonate,diethyl bromodifluoromethanephosphonate,diethyl bromodifluoromethylphosphonate,bromodifluoromethyl phosphonic acid diethyl ester,1-bromo difluoro methyl-ethoxyphosphoryl oxyethane,phosphonic acid, bromodifluoromethyl-, diethyl ester,pubchem24183,acmc-20ai7p |
| IUPAC Name | diethyl (bromodifluoromethyl)phosphonate |
| InChI Key | QRADKVYIJIAENZ-UHFFFAOYSA-N |
| Molecular Formula | C5H10BrF2O3P |
1,5-Pentylenediphosphonic Acid 98.0+%, TCI America™
CAS: 4672-25-7 Molecular Formula: C5H14O6P2 Molecular Weight (g/mol): 232.11 MDL Number: MFCD00800268 InChI Key: QRKINCQKOGXVEO-UHFFFAOYSA-N Synonym: 1,5-Pentanediphosphonic Acid PubChem CID: 2773804 IUPAC Name: (5-phosphonopentyl)phosphonic acid SMILES: OP(O)(=O)CCCCCP(O)(O)=O
| PubChem CID | 2773804 |
|---|---|
| CAS | 4672-25-7 |
| Molecular Weight (g/mol) | 232.11 |
| MDL Number | MFCD00800268 |
| SMILES | OP(O)(=O)CCCCCP(O)(O)=O |
| Synonym | 1,5-Pentanediphosphonic Acid |
| IUPAC Name | (5-phosphonopentyl)phosphonic acid |
| InChI Key | QRKINCQKOGXVEO-UHFFFAOYSA-N |
| Molecular Formula | C5H14O6P2 |
HATU 98.0+%, TCI America™
CAS: 148893-10-1 Molecular Formula: C10H15F6N6OP Molecular Weight (g/mol): 380.24 MDL Number: MFCD00274639 InChI Key: JNWBBCNCSMBKNE-UHFFFAOYSA-N Synonym: hatu,2-7-aza-1h-benzotriazole-1-yl-1,1,3,3-tetramethyluronium hexafluorophosphate,o-7-azabenzotriazol-1-yl-n,n,n',n'-tetramethyluronium hexafluorophosphate,o-7-azabenzotriazol-1-yl-n,n,n,n-tetramethyl uronium hexafluorophosphate,2-3h-1,2,3 triazolo 4,5-b pyridin-3-yl-1,1,3,3-tetramethyluronium hexafluorophosphate v,dimethylamino triazolo 4,5-b pyridin-3-yloxy methylene-dimethyl-ammonium hexafluorophosphate,2-7-aza-1h-benzotriazole-1-yl-1,1,3,3-tetramethyl uronium hexafluorophosphate,2-3h-1,2,3 triazolo 4,5-b pyridin-3-yl-1,1,3,3-tetramethylisouronium hexafluorophosphate v,n-dimethylamino 3h-1,2,3 triazolo 4,5-b pyridin-3-yloxy methylene-n-methylmethanaminium hexafluorophosphate,n-dimethylamino-1h-1,2,3-triazolo-4,5-b pyridin-1-ylmethylene-n-methylmethanaminium hexafluorophosphate n-oxide PubChem CID: 9886157 IUPAC Name: [(dimethylamino)({3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy})methylidene]dimethylazanium; hexafluoro-λ⁵-phosphanuide SMILES: F[P-](F)(F)(F)(F)F.CN(C)C(ON1N=NC2=CC=CN=C12)=[N+](C)C
| PubChem CID | 9886157 |
|---|---|
| CAS | 148893-10-1 |
| Molecular Weight (g/mol) | 380.24 |
| MDL Number | MFCD00274639 |
| SMILES | F[P-](F)(F)(F)(F)F.CN(C)C(ON1N=NC2=CC=CN=C12)=[N+](C)C |
| Synonym | hatu,2-7-aza-1h-benzotriazole-1-yl-1,1,3,3-tetramethyluronium hexafluorophosphate,o-7-azabenzotriazol-1-yl-n,n,n',n'-tetramethyluronium hexafluorophosphate,o-7-azabenzotriazol-1-yl-n,n,n,n-tetramethyl uronium hexafluorophosphate,2-3h-1,2,3 triazolo 4,5-b pyridin-3-yl-1,1,3,3-tetramethyluronium hexafluorophosphate v,dimethylamino triazolo 4,5-b pyridin-3-yloxy methylene-dimethyl-ammonium hexafluorophosphate,2-7-aza-1h-benzotriazole-1-yl-1,1,3,3-tetramethyl uronium hexafluorophosphate,2-3h-1,2,3 triazolo 4,5-b pyridin-3-yl-1,1,3,3-tetramethylisouronium hexafluorophosphate v,n-dimethylamino 3h-1,2,3 triazolo 4,5-b pyridin-3-yloxy methylene-n-methylmethanaminium hexafluorophosphate,n-dimethylamino-1h-1,2,3-triazolo-4,5-b pyridin-1-ylmethylene-n-methylmethanaminium hexafluorophosphate n-oxide |
| IUPAC Name | [(dimethylamino)({3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy})methylidene]dimethylazanium; hexafluoro-λ⁵-phosphanuide |
| InChI Key | JNWBBCNCSMBKNE-UHFFFAOYSA-N |
| Molecular Formula | C10H15F6N6OP |
Ethyl N-Phenylformimidate 98.0+%, TCI America™
CAS: 6780-49-0 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00043655 InChI Key: DRDBNKYFCOLNQO-UHFFFAOYSA-N Synonym: ethyl n-phenylformimidate,ethyl isoformanilide,n-ethoxymethyleneaniline,methanimidic acid, n-phenyl-, ethyl ester,ethyl phenylimidoformate,n-ethoxymethylene aniline,ethyl n-phenylcarboximidate,ethylisoformanilide,e-ethyl n-phenylcarboximidate,ethyl iso-formanilide PubChem CID: 111236 IUPAC Name: ethyl N-phenylcarboximidate SMILES: CCOC=NC1=CC=CC=C1
| PubChem CID | 111236 |
|---|---|
| CAS | 6780-49-0 |
| Molecular Weight (g/mol) | 149.19 |
| MDL Number | MFCD00043655 |
| SMILES | CCOC=NC1=CC=CC=C1 |
| Synonym | ethyl n-phenylformimidate,ethyl isoformanilide,n-ethoxymethyleneaniline,methanimidic acid, n-phenyl-, ethyl ester,ethyl phenylimidoformate,n-ethoxymethylene aniline,ethyl n-phenylcarboximidate,ethylisoformanilide,e-ethyl n-phenylcarboximidate,ethyl iso-formanilide |
| IUPAC Name | ethyl N-phenylcarboximidate |
| InChI Key | DRDBNKYFCOLNQO-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
O-[(Ethoxycarbonyl)cyanomethylenamino]-N,N,N',N'-tetramethyluronium Hexafluorophosphate 98.0+%, TCI America™
CAS: 333717-40-1 Molecular Formula: C10H17F6N4O3P Molecular Weight (g/mol): 386.235 MDL Number: MFCD01862832 InChI Key: RKTBAMPZUATMIO-JCTPKUEWSA-N Synonym: HOTU PubChem CID: 57416861 IUPAC Name: [[(Z)-(1-cyano-2-ethoxy-2-oxoethylidene)amino]oxy-(dimethylamino)methylidene]-dimethylazanium;hexafluorophosphate SMILES: CCOC(=O)C(=NOC(=[N+](C)C)N(C)C)C#N.F[P-](F)(F)(F)(F)F
| PubChem CID | 57416861 |
|---|---|
| CAS | 333717-40-1 |
| Molecular Weight (g/mol) | 386.235 |
| MDL Number | MFCD01862832 |
| SMILES | CCOC(=O)C(=NOC(=[N+](C)C)N(C)C)C#N.F[P-](F)(F)(F)(F)F |
| Synonym | HOTU |
| IUPAC Name | [[(Z)-(1-cyano-2-ethoxy-2-oxoethylidene)amino]oxy-(dimethylamino)methylidene]-dimethylazanium;hexafluorophosphate |
| InChI Key | RKTBAMPZUATMIO-JCTPKUEWSA-N |
| Molecular Formula | C10H17F6N4O3P |
Diethyl (3-Methylbenzyl)phosphonate 98.0+%, TCI America™
CAS: 63909-50-2 Molecular Formula: C12H19O3P Molecular Weight (g/mol): 242.255 InChI Key: LMLREDDVMFNSMK-UHFFFAOYSA-N Synonym: 3-(Diethylphosphonomethyl)toluene, (3-Methylbenzyl)phosphonic Acid Diethyl Ester PubChem CID: 10847732 IUPAC Name: 1-(diethoxyphosphorylmethyl)-3-methylbenzene SMILES: CCOP(=O)(CC1=CC=CC(=C1)C)OCC
| PubChem CID | 10847732 |
|---|---|
| CAS | 63909-50-2 |
| Molecular Weight (g/mol) | 242.255 |
| SMILES | CCOP(=O)(CC1=CC=CC(=C1)C)OCC |
| Synonym | 3-(Diethylphosphonomethyl)toluene, (3-Methylbenzyl)phosphonic Acid Diethyl Ester |
| IUPAC Name | 1-(diethoxyphosphorylmethyl)-3-methylbenzene |
| InChI Key | LMLREDDVMFNSMK-UHFFFAOYSA-N |
| Molecular Formula | C12H19O3P |
Tetraethyl p-Xylylenediphosphonate 95.0+%, TCI America™
CAS: 4546-04-7 Molecular Formula: C16H28O6P2 Molecular Weight (g/mol): 378.34 MDL Number: MFCD00671576 InChI Key: XTKQUBKFKSHRPS-UHFFFAOYSA-N Synonym: p-Bis(diethylphosphono)xylene, p-Xylylenediphosphonic Acid Tetraethyl Ester PubChem CID: 78303 IUPAC Name: 1,4-bis(diethoxyphosphorylmethyl)benzene SMILES: CCOP(=O)(CC1=CC=C(C=C1)CP(=O)(OCC)OCC)OCC
| PubChem CID | 78303 |
|---|---|
| CAS | 4546-04-7 |
| Molecular Weight (g/mol) | 378.34 |
| MDL Number | MFCD00671576 |
| SMILES | CCOP(=O)(CC1=CC=C(C=C1)CP(=O)(OCC)OCC)OCC |
| Synonym | p-Bis(diethylphosphono)xylene, p-Xylylenediphosphonic Acid Tetraethyl Ester |
| IUPAC Name | 1,4-bis(diethoxyphosphorylmethyl)benzene |
| InChI Key | XTKQUBKFKSHRPS-UHFFFAOYSA-N |
| Molecular Formula | C16H28O6P2 |
m-Xylylenediphosphonic Acid 97.0+%, TCI America™
CAS: 144052-40-4 Molecular Formula: C8H12O6P2 Molecular Weight (g/mol): 266.126 MDL Number: MFCD22200402 InChI Key: PYWZCUXISXXGMI-UHFFFAOYSA-N PubChem CID: 19352865 IUPAC Name: [3-(phosphonomethyl)phenyl]methylphosphonic acid SMILES: C1=CC(=CC(=C1)CP(=O)(O)O)CP(=O)(O)O
| PubChem CID | 19352865 |
|---|---|
| CAS | 144052-40-4 |
| Molecular Weight (g/mol) | 266.126 |
| MDL Number | MFCD22200402 |
| SMILES | C1=CC(=CC(=C1)CP(=O)(O)O)CP(=O)(O)O |
| IUPAC Name | [3-(phosphonomethyl)phenyl]methylphosphonic acid |
| InChI Key | PYWZCUXISXXGMI-UHFFFAOYSA-N |
| Molecular Formula | C8H12O6P2 |
Phenylphosphonic Acid 98.0+%, TCI America™
CAS: 1571-33-1 Molecular Formula: C6H7O3P Molecular Weight (g/mol): 158.09 MDL Number: MFCD00002136 InChI Key: QLZHNIAADXEJJP-UHFFFAOYSA-N Synonym: benzenephosphonic acid,phosphonic acid, phenyl,phenyl-phosphonic acid,phosphonic acid, p-phenyl,phenyl phosphonic acid,unii-byd76t2868,sv7,pubchem21303,phosphonic acid,phenyl,wln: qpqo&r PubChem CID: 15295 IUPAC Name: phenylphosphonic acid SMILES: OP(O)(=O)C1=CC=CC=C1
| PubChem CID | 15295 |
|---|---|
| CAS | 1571-33-1 |
| Molecular Weight (g/mol) | 158.09 |
| MDL Number | MFCD00002136 |
| SMILES | OP(O)(=O)C1=CC=CC=C1 |
| Synonym | benzenephosphonic acid,phosphonic acid, phenyl,phenyl-phosphonic acid,phosphonic acid, p-phenyl,phenyl phosphonic acid,unii-byd76t2868,sv7,pubchem21303,phosphonic acid,phenyl,wln: qpqo&r |
| IUPAC Name | phenylphosphonic acid |
| InChI Key | QLZHNIAADXEJJP-UHFFFAOYSA-N |
| Molecular Formula | C6H7O3P |
o-Xylylenediphosphonic Acid 97.0+%, TCI America™
CAS: 42104-58-5 Molecular Formula: C8H12O6P2 Molecular Weight (g/mol): 266.126 MDL Number: MFCD22200404 InChI Key: ZCVUWZJGYKGTPG-UHFFFAOYSA-N PubChem CID: 12471823 IUPAC Name: [2-(phosphonomethyl)phenyl]methylphosphonic acid SMILES: C1=CC=C(C(=C1)CP(=O)(O)O)CP(=O)(O)O
| PubChem CID | 12471823 |
|---|---|
| CAS | 42104-58-5 |
| Molecular Weight (g/mol) | 266.126 |
| MDL Number | MFCD22200404 |
| SMILES | C1=CC=C(C(=C1)CP(=O)(O)O)CP(=O)(O)O |
| IUPAC Name | [2-(phosphonomethyl)phenyl]methylphosphonic acid |
| InChI Key | ZCVUWZJGYKGTPG-UHFFFAOYSA-N |
| Molecular Formula | C8H12O6P2 |
Triethyl Phosphonoacetate 97.0+%, TCI America™
CAS: 867-13-0 Molecular Formula: C8H17O5P Molecular Weight (g/mol): 224.193 MDL Number: MFCD00009177 InChI Key: GGUBFICZYGKNTD-UHFFFAOYSA-N Synonym: triethyl phosphonoacetate,ethyl 2-diethoxyphosphoryl acetate,ethyl diethoxyphosphoryl acetate,ethyl diethylphosphono acetate,triethyl phosphonoethanoate,diethyl carboethoxymethylphosphonate,diethyl ethoxycarbonylmethanephosphonate,diethylphosphonoacetic acid ethyl ester,diethyl carbethoxymethylphosphonate PubChem CID: 13345 IUPAC Name: ethyl 2-diethoxyphosphorylacetate SMILES: CCOC(=O)CP(=O)(OCC)OCC
| PubChem CID | 13345 |
|---|---|
| CAS | 867-13-0 |
| Molecular Weight (g/mol) | 224.193 |
| MDL Number | MFCD00009177 |
| SMILES | CCOC(=O)CP(=O)(OCC)OCC |
| Synonym | triethyl phosphonoacetate,ethyl 2-diethoxyphosphoryl acetate,ethyl diethoxyphosphoryl acetate,ethyl diethylphosphono acetate,triethyl phosphonoethanoate,diethyl carboethoxymethylphosphonate,diethyl ethoxycarbonylmethanephosphonate,diethylphosphonoacetic acid ethyl ester,diethyl carbethoxymethylphosphonate |
| IUPAC Name | ethyl 2-diethoxyphosphorylacetate |
| InChI Key | GGUBFICZYGKNTD-UHFFFAOYSA-N |
| Molecular Formula | C8H17O5P |
4,4'-Bis(diethylphosphonomethyl)biphenyl 98.0+%, TCI America™
CAS: 17919-34-5 Molecular Formula: C22H32O6P2 Molecular Weight (g/mol): 454.44 MDL Number: MFCD01321144 InChI Key: DRCOGQJUVZRNSQ-UHFFFAOYSA-N PubChem CID: 635132 IUPAC Name: 1-(diethoxyphosphorylmethyl)-4-[4-(diethoxyphosphorylmethyl)phenyl]benzene SMILES: CCOP(=O)(CC1=CC=C(C=C1)C2=CC=C(C=C2)CP(=O)(OCC)OCC)OCC
| PubChem CID | 635132 |
|---|---|
| CAS | 17919-34-5 |
| Molecular Weight (g/mol) | 454.44 |
| MDL Number | MFCD01321144 |
| SMILES | CCOP(=O)(CC1=CC=C(C=C1)C2=CC=C(C=C2)CP(=O)(OCC)OCC)OCC |
| IUPAC Name | 1-(diethoxyphosphorylmethyl)-4-[4-(diethoxyphosphorylmethyl)phenyl]benzene |
| InChI Key | DRCOGQJUVZRNSQ-UHFFFAOYSA-N |
| Molecular Formula | C22H32O6P2 |
Tetradecylphosphonic Acid 98.0+%, TCI America™
CAS: 4671-75-4 Molecular Formula: C14H31O3P Molecular Weight (g/mol): 278.373 MDL Number: MFCD00015834 InChI Key: BVQJQTMSTANITJ-UHFFFAOYSA-N Synonym: phosphonic acid, tetradecyl,1-tetradecanephosphonic acid,tetradecanephosphonic acid,tetradecyl phosphonic acid,n-tetradecylphosphonic acid,tetradecyl-phosphonic acid,1-tetradecylphosphonic acid,phosphonic acid, p-tetradecyl,p-tetradecyl-phosphonic acid,tetradecylphosphonate PubChem CID: 78401 IUPAC Name: tetradecylphosphonic acid SMILES: CCCCCCCCCCCCCCP(=O)(O)O
| PubChem CID | 78401 |
|---|---|
| CAS | 4671-75-4 |
| Molecular Weight (g/mol) | 278.373 |
| MDL Number | MFCD00015834 |
| SMILES | CCCCCCCCCCCCCCP(=O)(O)O |
| Synonym | phosphonic acid, tetradecyl,1-tetradecanephosphonic acid,tetradecanephosphonic acid,tetradecyl phosphonic acid,n-tetradecylphosphonic acid,tetradecyl-phosphonic acid,1-tetradecylphosphonic acid,phosphonic acid, p-tetradecyl,p-tetradecyl-phosphonic acid,tetradecylphosphonate |
| IUPAC Name | tetradecylphosphonic acid |
| InChI Key | BVQJQTMSTANITJ-UHFFFAOYSA-N |
| Molecular Formula | C14H31O3P |
Tetraisopropyl Methylenediphosphonate 97.0+%, TCI America™
CAS: 1660-95-3 Molecular Formula: C13H30O6P2 Molecular Weight (g/mol): 344.325 MDL Number: MFCD00015021 InChI Key: ODTQUKVFOLFLIQ-UHFFFAOYSA-N Synonym: tetraisopropyl methylenediphosphonate,phosphonic acid, methylenebis-, tetrakis 1-methylethyl ester,tetraisopropyl methylenebisphosphonate,unii-k46y5v9u61,tetraisopropyl methylenebis phosphonate,methylenediphosphonic acid tetraisopropyl ester,tetra-i-propylmethylenediphosphonate,2-di propan-2-yloxy phosphorylmethyl-propan-2-yloxyphosphoryl oxypropane,phosphonic acid, p,p'-methylenebis-, p,p,p',p'-tetrakis 1-methylethyl ester,dsstox_cid_24847 PubChem CID: 74266 IUPAC Name: 2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane SMILES: CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C
| PubChem CID | 74266 |
|---|---|
| CAS | 1660-95-3 |
| Molecular Weight (g/mol) | 344.325 |
| MDL Number | MFCD00015021 |
| SMILES | CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C |
| Synonym | tetraisopropyl methylenediphosphonate,phosphonic acid, methylenebis-, tetrakis 1-methylethyl ester,tetraisopropyl methylenebisphosphonate,unii-k46y5v9u61,tetraisopropyl methylenebis phosphonate,methylenediphosphonic acid tetraisopropyl ester,tetra-i-propylmethylenediphosphonate,2-di propan-2-yloxy phosphorylmethyl-propan-2-yloxyphosphoryl oxypropane,phosphonic acid, p,p'-methylenebis-, p,p,p',p'-tetrakis 1-methylethyl ester,dsstox_cid_24847 |
| IUPAC Name | 2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane |
| InChI Key | ODTQUKVFOLFLIQ-UHFFFAOYSA-N |
| Molecular Formula | C13H30O6P2 |